2,3,3-trimethyl-1-(6-oxidanyl-6-oxidanylidene-hexyl)-2H-indole-5-sulfonate

Systemtic Name: 2,3,3-trimethyl-1-(6-oxidanyl-6-oxidanylidene-hexyl)-2H-indole-5-sulfonate Openeye Name: 1-(6-hydroxy-6-oxo-hexyl)-2,3,3-trimethyl-indoline-5-sulfonate CAS Name: 1-(6-hydroxy-6-oxohexyl)-2,3,3-trimethyl-2H-indole-5-sulfonate IUPAC Name: 1-(6-hydroxy-6-oxohexyl)-2,3,3-trimethyl-2H-indole-5-sulfonate Traditional Name: 1-(6-hydroxy-6-keto-hexyl)-2,3,3-trimethyl-indoline-5-sulfonate Formula: C17H24NO5S- MolecularWeight: 354.44116

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(N1CCCCCC(=O)O)C=CC(=C2)S(=O)(=O)[O-])(C)C

Isomeric SMILES

CC1C(C2=C(N1CCCCCC(=O)O)C=CC(=C2)S(=O)(=O)[O-])(C)C

InChI

InChI=1S/C17H25NO5S/c1-12-17(2,3)14-11-13(24(21,22)23)8-9-15(14)18(12)10-6-4-5-7-16(19)20/h8-9,11-12H,4-7,10H2,1-3H3,(H,19,20)(H,21,22,23)/p-1